(E)-3-[(3S)-6-chloranyl-8-nitro-3,4-dihydro-2H-chromen-3-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[(3S)-6-chloranyl-8-nitro-3,4-dihydro-2H-chromen-3-yl]prop-2-enoic acid Openeye Name: (E)-3-[(3S)-6-chloro-8-nitro-chroman-3-yl]prop-2-enoic acid CAS Name: (E)-3-[(3S)-6-chloro-8-nitro-3,4-dihydro-2H-1-benzopyran-3-yl]-2-propenoic acid IUPAC Name: (E)-3-[(3S)-6-chloro-8-nitro-3,4-dihydro-2H-chromen-3-yl]prop-2-enoic acid Traditional Name: (E)-3-[(3S)-6-chloro-8-nitro-chroman-3-yl]acrylic acid Formula: C12H10ClNO5 MolecularWeight: 283.6645

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=C(C=C(C=C21)Cl)[N+](=O)[O-])C=CC(=O)O

Isomeric SMILES

C1[C@H](COC2=C(C=C(C=C21)Cl)[N+](=O)[O-])/C=C/C(=O)O

InChI

InChI=1S/C12H10ClNO5/c13-9-4-8-3-7(1-2-11(15)16)6-19-12(8)10(5-9)14(17)18/h1-2,4-5,7H,3,6H2,(H,15,16)/b2-1+/t7-/m1/s1